Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-phenylpropyl]-

Base Information

Chemical Name:Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-phenylpropyl]-
CAS No.:162359-95-7
Molecular Formula:C17H23NO5
Molecular Weight:321.373
Hs Code.:
DSSTox Substance ID:DTXSID20441577
Wikidata:Q72444002
Mol file:162359-95-7.mol

Synonyms:162359-95-7;ACETAMIDE, N-[1,1-BIS[(ACETYLOXY)METHYL]-3-PHENYLPROPYL]-;[2-acetamido-2-(acetyloxymethyl)-4-phenylbutyl] acetate;SCHEMBL5035826;DTXSID20441577;2-acetamido-1, 3-diacetoxy-2-(2-phenylethyl)propane;acetic acid 2-acetoxymethyl-2-acetylamino-4-phenyl-butyl ester

Suppliers and Price of Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-phenylpropyl]-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-phenylpropyl]-

Chemical Property:

Melting Point:116-117℃
Boiling Point:498.6±45.0 °C(Predicted)
PKA:14.61±0.46(Predicted)
PSA：85.19000
Density:1.132±0.06 g/cm3 (20 oC 760 Torr)
LogP:2.46060
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:321.15762283
Heavy Atom Count:23
Complexity:397

Purity/Quality:: 99%, ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)NC(CCC1=CC=CC=C1)(COC(=O)C)COC(=O)C

Technology Process of Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-phenylpropyl]-

There total 7 articles about Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-phenylpropyl]- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 90.0%

: 108-24-7
acetic anhydride

: N-(1-hydroxy-2-(hydroxymethyl)-4-phenylbut-2-yl)acetamide

: 162359-95-7
2-acetamido-1,3-diacetoxy-2-(2-phenylethyl)propane

Guidance literature:: With pyridine; at 20 ℃; for 15h;
DOI:10.1039/c3ra40894a

Reference yield:

aqueous sodium sulfate: aqueous sodium sulfate

: 5463-92-3
2-acetylamino-2-phenylethylmalonic acid diethyl ester

: 162359-95-7
2-acetamido-1,3-diacetoxy-2-(2-phenylethyl)propane

Guidance literature:: With acetic anhydride; In tetrahydrofuran; pyridine;

Reference yield:

: 5463-92-3
2-acetylamino-2-phenylethylmalonic acid diethyl ester

: 162359-95-7
2-acetamido-1,3-diacetoxy-2-(2-phenylethyl)propane

Guidance literature:: Multi-step reaction with 2 steps

1: LiAlH₄ / tetrahydrofuran / 2 h / 20 °C

2: pyridine / 16 h / 20 °C

With pyridine; lithium aluminium tetrahydride; In tetrahydrofuran; 1: Reduction / 2: Acetylation;
DOI:10.1021/jm000173z